carbane;carbon dioxide

C2H4O2 — CID 173372193

IUPACcarbane;carbon dioxide
SMILESO=C=O.[11CH4]
InChIInChI=1S/CO2.CH4/c2-1-3;/h;1H4/i;1-1
InChIKeyKDRIEERWEFJUSB-HCMAANCNSA-N
MW59.05 g/mol
LogP0.05
Rot. Bonds

About carbane;carbon dioxide

carbane;carbon dioxide (PubChem CID 173372193) has the molecular formula C2H4O2 and a molecular weight of 59.05 g/mol. Its IUPAC name is carbane;carbon dioxide.

Molecular Properties

Compound Namecarbane;carbon dioxide
PubChem CID173372193
Molecular FormulaC2H4O2
Molecular Weight59.05 g/mol
Exact Mass59.03
IUPAC Namecarbane;carbon dioxide
SMILESO=C=O.[11CH4]
InChIInChI=1S/CO2.CH4/c2-1-3;/h;1H4/i;1-1
InChIKeyKDRIEERWEFJUSB-HCMAANCNSA-N
XLogP0.05
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50059.05
LogP ≤ 50.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of carbane;carbon dioxide?
The IUPAC name of carbane;carbon dioxide (CID 173372193) is carbane;carbon dioxide.
What is the SMILES notation for carbane;carbon dioxide?
The canonical SMILES for carbane;carbon dioxide is O=C=O.[11CH4].
What is the InChIKey of carbane;carbon dioxide?
The InChIKey is KDRIEERWEFJUSB-HCMAANCNSA-N. The full InChI is InChI=1S/CO2.CH4/c2-1-3;/h;1H4/i;1-1.
What are the key properties of carbane;carbon dioxide?
carbane;carbon dioxide has a molecular weight of 59.05 g/mol, XLogP of 0.05, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbane;carbon dioxide is sourced from PubChem (CID 173372193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).